| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: (2R)-N2,N2,3-trimethyl-N1-[(S)-(1-methylimidazol-2-yl)-(2-thienyl)methyl]butane-1,2-diamine (2R)-N2,N2,3-trimethyl-N1-[(S)-(…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.47 | 9.69 | -84.92 | 3 | 4 | 2 | 36 | 308.495 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 7.28 | -6.65 | 1 | 4 | 0 | 33 | 306.479 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 9.12 | -32.24 | 2 | 4 | 1 | 34 | 307.487 | 7 | ↓ |
